N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide

C15H18N6OS — CID 172900415

IUPACN-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide
SMILESO=C(NC1CCN(c2nc(C3CC3)ns2)CC1)c1cnccn1
InChIInChI=1S/C15H18N6OS/c22-14(12-9-16-5-6-17-12)18-11-3-7-21(8-4-11)15-19-13(20-23-15)10-1-2-10/h5-6,9-11H,1-4,7-8H2,(H,18,22)
InChIKeyGDRWSIGJJACODF-UHFFFAOYSA-N
MW330.42 g/mol
LogP1.60
Rot. Bonds4

About N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide

N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide (PubChem CID 172900415) has the molecular formula C15H18N6OS and a molecular weight of 330.42 g/mol. Its IUPAC name is N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide
PubChem CID172900415
Molecular FormulaC15H18N6OS
Molecular Weight330.42 g/mol
Exact Mass330.13
IUPAC NameN-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide
SMILESO=C(NC1CCN(c2nc(C3CC3)ns2)CC1)c1cnccn1
InChIInChI=1S/C15H18N6OS/c22-14(12-9-16-5-6-17-12)18-11-3-7-21(8-4-11)15-19-13(20-23-15)10-1-2-10/h5-6,9-11H,1-4,7-8H2,(H,18,22)
InChIKeyGDRWSIGJJACODF-UHFFFAOYSA-N
XLogP1.60
TPSA83.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.42
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[1-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)piperidin-4-yl]pyrazine-2-carboxamide
CID 172903854
N-(1-quinoxalin-2-ylpiperidin-4-yl)pyrazine-2-carboxamide
CID 172903561
N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrimidine-4-carboxamide
CID 175648747
methyl 4-(pyrazine-2-carbonylamino)piperidine-1-carboxylate
CID 110821817
N-[1-(3-cyclobutyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrimidin-4-amine
CID 126887407
N-[1-(3,5-dichloro-2-pyridinyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 172900971
N-[1-(5-bromo-4-methoxypyrimidin-2-yl)piperidin-4-yl]pyrazine-2-carboxamide
CID 172901024
N-(4,4-dimethylcyclohexyl)pyrazine-2-carboxamide
CID 130233496
N-[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]pyrazine-2-carboxamide
CID 124759114
N-[1-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]pyrazine-2-carboxamide
CID 172902959
N-[1-(4-chlorobutanoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 108562614
2-methylpropyl 4-(pyrazine-2-carbonylamino)piperidine-1-carboxylate
CID 108562616

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide?
The IUPAC name of N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide (CID 172900415) is N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide is O=C(NC1CCN(c2nc(C3CC3)ns2)CC1)c1cnccn1.
What is the InChIKey of N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide?
The InChIKey is GDRWSIGJJACODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6OS/c22-14(12-9-16-5-6-17-12)18-11-3-7-21(8-4-11)15-19-13(20-23-15)10-1-2-10/h5-6,9-11H,1-4,7-8H2,(H,18,22).
What are the key properties of N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide?
N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide has a molecular weight of 330.42 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 172900415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).